methyl 2-[[4-[(4-methyl-3-pyrrol-1-yl-phenyl)carbonylamino]phenyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[4-[(4-methyl-3-pyrrol-1-yl-phenyl)carbonylamino]phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[4-[(4-methyl-3-pyrrol-1-yl-benzoyl)amino]benzoyl]amino]acetate CAS Name: 2-[[[4-[[[4-methyl-3-(1-pyrrolyl)phenyl]-oxomethyl]amino]phenyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[(4-methyl-3-pyrrol-1-ylbenzoyl)amino]benzoyl]amino]acetate Traditional Name: 2-[[4-[(4-methyl-3-pyrrol-1-yl-benzoyl)amino]benzoyl]amino]acetic acid methyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NCC(=O)OC)N3C=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NCC(=O)OC)N3C=CC=C3

InChI

InChI=1S/C22H21N3O4/c1-15-5-6-17(13-19(15)25-11-3-4-12-25)22(28)24-18-9-7-16(8-10-18)21(27)23-14-20(26)29-2/h3-13H,14H2,1-2H3,(H,23,27)(H,24,28)