N-(3-methoxypropyl)-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-4-nitro-benzamide

Systemtic Name: N-(3-methoxypropyl)-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-4-nitro-benzamide Openeye Name: N-(3-methoxypropyl)-4-nitro-N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]benzamide CAS Name: N-(3-methoxypropyl)-N-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-4-nitrobenzamide IUPAC Name: N-(3-methoxypropyl)-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-4-nitrobenzamide Traditional Name: N-(3-methoxypropyl)-N-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-4-nitro-benzamide Formula: C24H27N3O4 MolecularWeight: 421.48888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2CN(CCCOC)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2CN(CCCOC)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H27N3O4/c1-19-7-3-4-8-21(19)17-25-14-5-9-23(25)18-26(15-6-16-31-2)24(28)20-10-12-22(13-11-20)27(29)30/h3-5,7-14H,6,15-18H2,1-2H3