methyl 3-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[(4-dimethylaminophenyl)methyl-methyl-amino]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[(4-dimethylaminophenyl)methyl-methylamino]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[(4-dimethylaminophenyl)methyl-methylamino]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[[4-(dimethylamino)benzyl]-methyl-amino]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C)CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C)CC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C21H27N3O3/c1-15-6-9-17(21(26)27-5)12-19(15)22-20(25)14-24(4)13-16-7-10-18(11-8-16)23(2)3/h6-12H,13-14H2,1-5H3,(H,22,25)