ethyl (E)-4-[(5-methyl-1H-indol-2-yl)carbonyl-[(1S)-1-phenylethyl]amino]but-2-enoate

Systemtic Name: ethyl (E)-4-[(5-methyl-1H-indol-2-yl)carbonyl-[(1S)-1-phenylethyl]amino]but-2-enoate Openeye Name: ethyl (E)-4-[(5-methyl-1H-indole-2-carbonyl)-[(1S)-1-phenylethyl]amino]but-2-enoate CAS Name: (E)-4-[[(5-methyl-1H-indol-2-yl)-oxomethyl]-[(1S)-1-phenylethyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[(5-methyl-1H-indole-2-carbonyl)-[(1S)-1-phenylethyl]amino]but-2-enoate Traditional Name: (E)-4-[(5-methyl-1H-indole-2-carbonyl)-[(1S)-1-phenylethyl]amino]but-2-enoic acid ethyl ester Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCN(C(C)C1=CC=CC=C1)C(=O)C2=CC3=C(N2)C=CC(=C3)C

Isomeric SMILES

CCOC(=O)/C=C/CN([C@@H](C)C1=CC=CC=C1)C(=O)C2=CC3=C(N2)C=CC(=C3)C

InChI

InChI=1S/C24H26N2O3/c1-4-29-23(27)11-8-14-26(18(3)19-9-6-5-7-10-19)24(28)22-16-20-15-17(2)12-13-21(20)25-22/h5-13,15-16,18,25H,4,14H2,1-3H3/b11-8+/t18-/m0/s1