methyl 4-[[2-[1-(3-benzamidophenyl)ethyl-methyl-amino]ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[1-(3-benzamidophenyl)ethyl-methyl-amino]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[1-(3-benzamidophenyl)ethyl-methyl-amino]acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[1-(3-benzamidophenyl)ethyl-methylamino]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[1-(3-benzamidophenyl)ethyl-methylamino]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[1-(3-benzamidophenyl)ethyl-methyl-amino]acetyl]amino]methyl]benzoic acid methyl ester Formula: C27H29N3O4 MolecularWeight: 459.53686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C27H29N3O4/c1-19(23-10-7-11-24(16-23)29-26(32)21-8-5-4-6-9-21)30(2)18-25(31)28-17-20-12-14-22(15-13-20)27(33)34-3/h4-16,19H,17-18H2,1-3H3,(H,28,31)(H,29,32)