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

Systemtic Name: 2-azanyl-N-[2-methyl-4-[methyl-[2-(4-methylpiperazin-1-yl)phenyl]carbamoyl]phenyl]-3-nitro-benzamide Openeye Name: 2-amino-N-[2-methyl-4-[methyl-[2-(4-methylpiperazin-1-yl)phenyl]carbamoyl]phenyl]-3-nitro-benzamide CAS Name: 2-amino-N-[2-methyl-4-[[N-methyl-2-(4-methyl-1-piperazinyl)anilino]-oxomethyl]phenyl]-3-nitrobenzamide IUPAC Name: 2-amino-N-[2-methyl-4-[methyl-[2-(4-methylpiperazin-1-yl)phenyl]carbamoyl]phenyl]-3-nitrobenzamide Traditional Name: 2-amino-N-[2-methyl-4-[methyl-[2-(4-methylpiperazino)phenyl]carbamoyl]phenyl]-3-nitro-benzamide Formula: C27H30N6O4 MolecularWeight: 502.5649

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N(C)C2=CC=CC=C2N3CCN(CC3)C)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])N

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N(C)C2=CC=CC=C2N3CCN(CC3)C)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])N

InChI

InChI=1S/C27H30N6O4/c1-18-17-19(11-12-21(18)29-26(34)20-7-6-10-24(25(20)28)33(36)37)27(35)31(3)22-8-4-5-9-23(22)32-15-13-30(2)14-16-32/h4-12,17H,13-16,28H2,1-3H3,(H,29,34)