ethyl 2-[[1H-indol-2-ylcarbonyl(propan-2-yl)amino]methyl]-4-phenyl-butanoate

Systemtic Name: ethyl 2-[[1H-indol-2-ylcarbonyl(propan-2-yl)amino]methyl]-4-phenyl-butanoate Openeye Name: ethyl 2-[[1H-indole-2-carbonyl(isopropyl)amino]methyl]-4-phenyl-butanoate CAS Name: 2-[[[1H-indol-2-yl(oxo)methyl]-propan-2-ylamino]methyl]-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[[1H-indole-2-carbonyl(propan-2-yl)amino]methyl]-4-phenylbutanoate Traditional Name: 2-[[1H-indole-2-carbonyl(isopropyl)amino]methyl]-4-phenyl-butyric acid ethyl ester Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)CN(C(C)C)C(=O)C2=CC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)CN(C(C)C)C(=O)C2=CC3=CC=CC=C3N2

InChI

InChI=1S/C25H30N2O3/c1-4-30-25(29)21(15-14-19-10-6-5-7-11-19)17-27(18(2)3)24(28)23-16-20-12-8-9-13-22(20)26-23/h5-13,16,18,21,26H,4,14-15,17H2,1-3H3