methyl 2-[(4-butoxyphenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[(4-butoxyphenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[(4-butoxybenzoyl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[(4-butoxyphenyl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[(4-butoxybenzoyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[(4-butoxybenzoyl)amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C23H26N2O4 MolecularWeight: 394.46354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C23H26N2O4/c1-3-4-13-29-18-11-9-16(10-12-18)22(26)25-21(23(27)28-2)14-17-15-24-20-8-6-5-7-19(17)20/h5-12,15,21,24H,3-4,13-14H2,1-2H3,(H,25,26)