N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-3-nitro-N-propyl-benzamide

Systemtic Name: N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-3-nitro-N-propyl-benzamide Openeye Name: N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]-3-nitro-N-propyl-benzamide CAS Name: N-[2-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]-3-nitro-N-propylbenzamide IUPAC Name: N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]-3-nitro-N-propylbenzamide Traditional Name: N-[2-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]-3-nitro-N-propyl-benzamide Formula: C30H35ClN4O4 MolecularWeight: 551.0763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2Cl)C3CCCCC3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2Cl)C3CCCCC3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C30H35ClN4O4/c1-2-17-33(30(37)23-11-8-14-26(19-23)35(38)39)22-29(36)34(25-12-4-3-5-13-25)21-27-15-9-18-32(27)20-24-10-6-7-16-28(24)31/h6-11,14-16,18-19,25H,2-5,12-13,17,20-22H2,1H3