methyl 4-[[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[cyclopropyl(p-anisyl)amino]acetyl]amino]methyl]benzoic acid methyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC(=O)NCC2=CC=C(C=C2)C(=O)OC)C3CC3

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC(=O)NCC2=CC=C(C=C2)C(=O)OC)C3CC3

InChI

InChI=1S/C22H26N2O4/c1-27-20-11-5-17(6-12-20)14-24(19-9-10-19)15-21(25)23-13-16-3-7-18(8-4-16)22(26)28-2/h3-8,11-12,19H,9-10,13-15H2,1-2H3,(H,23,25)