methyl 4-[[methyl-[4-[(propan-2-ylcarbamoylamino)methyl]phenyl]carbonyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[methyl-[4-[(propan-2-ylcarbamoylamino)methyl]phenyl]carbonyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[4-[(isopropylcarbamoylamino)methyl]benzoyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[methyl-[oxo-[4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]phenyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[methyl-[4-[(propan-2-ylcarbamoylamino)methyl]benzoyl]amino]methyl]benzoate Traditional Name: 4-[[[4-[(isopropylcarbamoylamino)methyl]benzoyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N(C)CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N(C)CC2=CC=C(C=C2)C(=O)OC

InChI

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