ethyl 2-[5-(3,3-dimethylbutanoylamino)-2-(phenylcarbamoyl)indol-1-yl]ethanoate

Systemtic Name: ethyl 2-[5-(3,3-dimethylbutanoylamino)-2-(phenylcarbamoyl)indol-1-yl]ethanoate Openeye Name: ethyl 2-[5-(3,3-dimethylbutanoylamino)-2-(phenylcarbamoyl)indol-1-yl]acetate CAS Name: 2-[2-[anilino(oxo)methyl]-5-[(3,3-dimethyl-1-oxobutyl)amino]-1-indolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(3,3-dimethylbutanoylamino)-2-(phenylcarbamoyl)indol-1-yl]acetate Traditional Name: 2-[5-(3,3-dimethylbutanoylamino)-2-(phenylcarbamoyl)indol-1-yl]acetic acid ethyl ester Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)NC(=O)CC(C)(C)C)C=C1C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)NC(=O)CC(C)(C)C)C=C1C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C25H29N3O4/c1-5-32-23(30)16-28-20-12-11-19(26-22(29)15-25(2,3)4)13-17(20)14-21(28)24(31)27-18-9-7-6-8-10-18/h6-14H,5,15-16H2,1-4H3,(H,26,29)(H,27,31)