ethyl 3-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methylcarbamoylamino]benzoate

Systemtic Name: ethyl 3-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methylcarbamoylamino]benzoate Openeye Name: ethyl 3-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methylcarbamoylamino]benzoate CAS Name: 3-[[[[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]methylamino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]methylcarbamoylamino]benzoate Traditional Name: 3-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methylcarbamoylamino]benzoic acid ethyl ester Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)NCC2=C(N(C(=C2)C)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)NCC2=C(N(C(=C2)C)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C24H27N3O4/c1-5-31-23(28)18-7-6-8-20(14-18)26-24(29)25-15-19-13-16(2)27(17(19)3)21-9-11-22(30-4)12-10-21/h6-14H,5,15H2,1-4H3,(H2,25,26,29)