(phenylmethyl) 2-(3-cyclohexylpropoxycarbonylamino)-3-(1H-indol-3-yl)propanoate

Systemtic Name: (phenylmethyl) 2-(3-cyclohexylpropoxycarbonylamino)-3-(1H-indol-3-yl)propanoate Openeye Name: benzyl 2-(3-cyclohexylpropoxycarbonylamino)-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[3-cyclohexylpropoxy(oxo)methyl]amino]-3-(1H-indol-3-yl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(3-cyclohexylpropoxycarbonylamino)-3-(1H-indol-3-yl)propanoate Traditional Name: 2-(3-cyclohexylpropoxycarbonylamino)-3-(1H-indol-3-yl)propionic acid benzyl ester Formula: C28H34N2O4 MolecularWeight: 462.58056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCOC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CCCOC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H34N2O4/c31-27(34-20-22-12-5-2-6-13-22)26(18-23-19-29-25-16-8-7-15-24(23)25)30-28(32)33-17-9-14-21-10-3-1-4-11-21/h2,5-8,12-13,15-16,19,21,26,29H,1,3-4,9-11,14,17-18,20H2,(H,30,32)