methyl 5-[4-[aminocarbonyl(oxidanyl)amino]butyl]-2-[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]ethoxy]benzoate

Systemtic Name: methyl 5-[4-[aminocarbonyl(oxidanyl)amino]butyl]-2-[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]ethoxy]benzoate Openeye Name: methyl 5-[4-[carbamoyl(hydroxy)amino]butyl]-2-[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]ethoxy]benzoate CAS Name: 5-[4-[carbamoyl(hydroxy)amino]butyl]-2-[2-[4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]ethoxy]benzoic acid methyl ester IUPAC Name: methyl 5-[4-[carbamoyl(hydroxy)amino]butyl]-2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]benzoate Traditional Name: 5-[4-[carbamoyl(hydroxy)amino]butyl]-2-[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino]ethoxy]benzoic acid methyl ester Formula: C32H39ClN4O5 MolecularWeight: 595.12886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)CCCCN(C(=O)N)O)OCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)CCCCN(C(=O)N)O)OCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C32H39ClN4O5/c1-41-31(38)28-23-24(7-5-6-16-37(40)32(34)39)10-15-29(28)42-22-21-35-17-19-36(20-18-35)30(25-8-3-2-4-9-25)26-11-13-27(33)14-12-26/h2-4,8-15,23,30,40H,5-7,16-22H2,1H3,(H2,34,39)