methyl 3-[(3-bromanyl-1-methyl-indol-2-yl)carbonylamino]-3-(3,4-dimethoxyphenyl)propanoate

Systemtic Name: methyl 3-[(3-bromanyl-1-methyl-indol-2-yl)carbonylamino]-3-(3,4-dimethoxyphenyl)propanoate Openeye Name: methyl 3-[(3-bromo-1-methyl-indole-2-carbonyl)amino]-3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-[[(3-bromo-1-methyl-2-indolyl)-oxomethyl]amino]-3-(3,4-dimethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-[(3-bromo-1-methylindole-2-carbonyl)amino]-3-(3,4-dimethoxyphenyl)propanoate Traditional Name: 3-[(3-bromo-1-methyl-indole-2-carbonyl)amino]-3-(3,4-dimethoxyphenyl)propionic acid methyl ester Formula: C22H23BrN2O5 MolecularWeight: 475.33242

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)NC(CC(=O)OC)C3=CC(=C(C=C3)OC)OC)Br

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)NC(CC(=O)OC)C3=CC(=C(C=C3)OC)OC)Br

InChI

InChI=1S/C22H23BrN2O5/c1-25-16-8-6-5-7-14(16)20(23)21(25)22(27)24-15(12-19(26)30-4)13-9-10-17(28-2)18(11-13)29-3/h5-11,15H,12H2,1-4H3,(H,24,27)