N-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-4-methyl-cyclohexane-1-carboxamide

Systemtic Name: N-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-4-methyl-cyclohexane-1-carboxamide Openeye Name: N-[(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-4-methyl-cyclohexanecarboxamide CAS Name: N-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-4-methyl-1-cyclohexanecarboxamide IUPAC Name: N-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-4-methylcyclohexane-1-carboxamide Traditional Name: N-[(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-4-methyl-cyclohexanecarboxamide Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC1CCC(CC1)C(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)NC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C27H31N3O4/c1-17-6-8-18(9-7-17)26(31)30-23(14-19-16-28-22-5-3-2-4-21(19)22)27(32)29-20-10-11-24-25(15-20)34-13-12-33-24/h2-5,10-11,15-18,23,28H,6-9,12-14H2,1H3,(H,29,32)(H,30,31)/t17?,18?,23-/m1/s1