[3-(2-azanyl-2-oxidanylidene-ethyl)-1-(4-butylphenyl)carbonyl-2-methyl-indol-5-yl] ethanoate

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-1-(4-butylphenyl)carbonyl-2-methyl-indol-5-yl] ethanoate Openeye Name: [3-(2-amino-2-oxo-ethyl)-1-(4-butylbenzoyl)-2-methyl-indol-5-yl] acetate CAS Name: acetic acid [3-(2-amino-2-oxoethyl)-1-[(4-butylphenyl)-oxomethyl]-2-methyl-5-indolyl] ester IUPAC Name: [3-(2-amino-2-oxoethyl)-1-(4-butylbenzoyl)-2-methylindol-5-yl] acetate Traditional Name: acetic acid [3-(2-amino-2-keto-ethyl)-1-(4-butylbenzoyl)-2-methyl-indol-5-yl] ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N2C(=C(C3=C2C=CC(=C3)OC(=O)C)CC(=O)N)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N2C(=C(C3=C2C=CC(=C3)OC(=O)C)CC(=O)N)C

InChI

InChI=1S/C24H26N2O4/c1-4-5-6-17-7-9-18(10-8-17)24(29)26-15(2)20(14-23(25)28)21-13-19(30-16(3)27)11-12-22(21)26/h7-13H,4-6,14H2,1-3H3,(H2,25,28)