phenacyl 2-[(4-tert-butylphenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: phenacyl 2-[(4-tert-butylphenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: phenacyl 2-[(4-tert-butylbenzoyl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid phenacyl ester IUPAC Name: phenacyl 2-[(4-tert-butylbenzoyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[(4-tert-butylbenzoyl)amino]-3-(1H-indol-3-yl)propionic acid phenacyl ester Formula: C30H30N2O4 MolecularWeight: 482.5702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H30N2O4/c1-30(2,3)23-15-13-21(14-16-23)28(34)32-26(17-22-18-31-25-12-8-7-11-24(22)25)29(35)36-19-27(33)20-9-5-4-6-10-20/h4-16,18,26,31H,17,19H2,1-3H3,(H,32,34)