ethyl 4-[[5-bromanyl-3-(2-dimethylaminoethyl)indol-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[5-bromanyl-3-(2-dimethylaminoethyl)indol-1-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[5-bromo-3-(2-dimethylaminoethyl)indole-1-carbonyl]amino]benzoate CAS Name: 4-[[[5-bromo-3-(2-dimethylaminoethyl)-1-indolyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-bromo-3-(2-dimethylaminoethyl)indole-1-carbonyl]amino]benzoate Traditional Name: 4-[[5-bromo-3-(2-dimethylaminoethyl)indole-1-carbonyl]amino]benzoic acid ethyl ester Formula: C22H24BrN3O3 MolecularWeight: 458.34826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2C=C(C3=C2C=CC(=C3)Br)CCN(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2C=C(C3=C2C=CC(=C3)Br)CCN(C)C

InChI

InChI=1S/C22H24BrN3O3/c1-4-29-21(27)15-5-8-18(9-6-15)24-22(28)26-14-16(11-12-25(2)3)19-13-17(23)7-10-20(19)26/h5-10,13-14H,4,11-12H2,1-3H3,(H,24,28)