methyl 3-[(2-methoxy-3-methyl-phenyl)carbonylamino]-4-(4-methylpiperazin-1-yl)benzoate

Systemtic Name: methyl 3-[(2-methoxy-3-methyl-phenyl)carbonylamino]-4-(4-methylpiperazin-1-yl)benzoate Openeye Name: methyl 3-[(2-methoxy-3-methyl-benzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate CAS Name: 3-[[(2-methoxy-3-methylphenyl)-oxomethyl]amino]-4-(4-methyl-1-piperazinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(2-methoxy-3-methylbenzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate Traditional Name: 3-[(2-methoxy-3-methyl-benzoyl)amino]-4-(4-methylpiperazino)benzoic acid methyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C

Isomeric SMILES

CC1=CC=CC(=C1OC)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C

InChI

InChI=1S/C22H27N3O4/c1-15-6-5-7-17(20(15)28-3)21(26)23-18-14-16(22(27)29-4)8-9-19(18)25-12-10-24(2)11-13-25/h5-9,14H,10-13H2,1-4H3,(H,23,26)