N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-methyl-4-(4-methylpiperazino)phenyl]-3-nitro-4-pyrrolidino-benzamide Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H29N5O3/c1-17-15-19(26-13-11-25(2)12-14-26)6-7-20(17)24-23(29)18-5-8-21(22(16-18)28(30)31)27-9-3-4-10-27/h5-8,15-16H,3-4,9-14H2,1-2H3,(H,24,29)