ethyl 2-[4-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]phenyl]ethanoate

Systemtic Name: ethyl 2-[4-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]phenyl]ethanoate Openeye Name: ethyl 2-[4-[[1-(m-tolylmethyl)pyrrol-2-yl]methylcarbamoylamino]phenyl]acetate CAS Name: 2-[4-[[[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methylamino]-oxomethyl]amino]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]phenyl]acetate Traditional Name: 2-[4-[[1-(3-methylbenzyl)pyrrol-2-yl]methylcarbamoylamino]phenyl]acetic acid ethyl ester Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)NC(=O)NCC2=CC=CN2CC3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)NC(=O)NCC2=CC=CN2CC3=CC=CC(=C3)C

InChI

InChI=1S/C24H27N3O3/c1-3-30-23(28)15-19-9-11-21(12-10-19)26-24(29)25-16-22-8-5-13-27(22)17-20-7-4-6-18(2)14-20/h4-14H,3,15-17H2,1-2H3,(H2,25,26,29)