methyl 2-[3-(7-bromanyl-2-phenyl-1H-indol-3-yl)propanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[3-(7-bromanyl-2-phenyl-1H-indol-3-yl)propanoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[3-(7-bromo-2-phenyl-1H-indol-3-yl)propanoylamino]-3-phenyl-propanoate CAS Name: 2-[[3-(7-bromo-2-phenyl-1H-indol-3-yl)-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[3-(7-bromo-2-phenyl-1H-indol-3-yl)propanoylamino]-3-phenylpropanoate Traditional Name: 2-[3-(7-bromo-2-phenyl-1H-indol-3-yl)propanoylamino]-3-phenyl-propionic acid methyl ester Formula: C27H25BrN2O3 MolecularWeight: 505.403

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CCC2=C(NC3=C2C=CC=C3Br)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)CCC2=C(NC3=C2C=CC=C3Br)C4=CC=CC=C4

InChI

InChI=1S/C27H25BrN2O3/c1-33-27(32)23(17-18-9-4-2-5-10-18)29-24(31)16-15-21-20-13-8-14-22(28)26(20)30-25(21)19-11-6-3-7-12-19/h2-14,23,30H,15-17H2,1H3,(H,29,31)