2-[2,3-dihydro-1H-inden-5-yl-[[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]-methyl-carbamoyl]amino]ethanoic acid

Systemtic Name: 2-[2,3-dihydro-1H-inden-5-yl-[[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]-methyl-carbamoyl]amino]ethanoic acid Openeye Name: 2-[[[(1-ethoxycarbonyl-3-phenyl-propyl)amino]-methyl-carbamoyl]-indan-5-yl-amino]acetic acid CAS Name: 2-[2,3-dihydro-1H-inden-5-yl-[[[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-methylamino]-oxomethyl]amino]acetic acid IUPAC Name: 2-[2,3-dihydro-1H-inden-5-yl-[[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-methylcarbamoyl]amino]acetic acid Traditional Name: 2-[[[(1-carbethoxy-3-phenyl-propyl)amino]-methyl-carbamoyl]-indan-5-yl-amino]acetic acid Formula: C25H31N3O5 MolecularWeight: 453.53074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NN(C)C(=O)N(CC(=O)O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NN(C)C(=O)N(CC(=O)O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C25H31N3O5/c1-3-33-24(31)22(15-12-18-8-5-4-6-9-18)26-27(2)25(32)28(17-23(29)30)21-14-13-19-10-7-11-20(19)16-21/h4-6,8-9,13-14,16,22,26H,3,7,10-12,15,17H2,1-2H3,(H,29,30)