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

Systemtic Name: methyl 3-[2-[[4-(cyclopropylcarbamoyl)phenyl]methyl-methyl-amino]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[[4-(cyclopropylcarbamoyl)phenyl]methyl-methyl-amino]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[[4-[(cyclopropylamino)-oxomethyl]phenyl]methyl-methylamino]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[[4-(cyclopropylcarbamoyl)phenyl]methyl-methylamino]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[[4-(cyclopropylcarbamoyl)benzyl]-methyl-amino]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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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)C(=O)NC3CC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C)CC2=CC=C(C=C2)C(=O)NC3CC3

InChI

InChI=1S/C23H27N3O4/c1-15-4-7-18(23(29)30-3)12-20(15)25-21(27)14-26(2)13-16-5-8-17(9-6-16)22(28)24-19-10-11-19/h4-9,12,19H,10-11,13-14H2,1-3H3,(H,24,28)(H,25,27)