N-cyclohexylcyclohexanamine; (3R)-3-(6-methoxypyridin-3-yl)-3-[2-oxidanylidene-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid

Systemtic Name: N-cyclohexylcyclohexanamine; (3R)-3-(6-methoxypyridin-3-yl)-3-[2-oxidanylidene-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid Openeye Name: N-cyclohexylcyclohexanamine; (3R)-3-(6-methoxy-3-pyridyl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid CAS Name: N-cyclohexylcyclohexanamine; (3R)-3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-1-imidazolidinyl]propanoic acid IUPAC Name: N-cyclohexylcyclohexanamine; (3R)-3-(6-methoxypyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid Traditional Name: dicyclohexylamine; (3R)-3-[2-keto-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]-3-(6-methoxy-3-pyridyl)propionic acid Formula: C35H52N6O4 MolecularWeight: 620.82518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)C(CC(=O)O)N2CCN(C2=O)CCCC3=NC4=C(CCCN4)C=C3.C1CCC(CC1)NC2CCCCC2

Isomeric SMILES

COC1=NC=C(C=C1)[C@@H](CC(=O)O)N2CCN(C2=O)CCCC3=NC4=C(CCCN4)C=C3.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C23H29N5O4.C12H23N/c1-32-20-9-7-17(15-25-20)19(14-21(29)30)28-13-12-27(23(28)31)11-3-5-18-8-6-16-4-2-10-24-22(16)26-18;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h6-9,15,19H,2-5,10-14H2,1H3,(H,24,26)(H,29,30);11-13H,1-10H2/t19-;/m1./s1