N-[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]-3-methoxy-4-nitro-benzamide

Systemtic Name: N-[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]-3-methoxy-4-nitro-benzamide Openeye Name: N-[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]-3-methoxy-4-nitro-benzamide CAS Name: N-[4-[4-(cyclopropylmethyl)-1-piperazinyl]cyclohexyl]-3-methoxy-4-nitrobenzamide IUPAC Name: N-[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]-3-methoxy-4-nitrobenzamide Traditional Name: N-[4-[4-(cyclopropylmethyl)piperazino]cyclohexyl]-3-methoxy-4-nitro-benzamide Formula: C22H32N4O4 MolecularWeight: 416.51388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)N3CCN(CC3)CC4CC4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)N3CCN(CC3)CC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C22H32N4O4/c1-30-21-14-17(4-9-20(21)26(28)29)22(27)23-18-5-7-19(8-6-18)25-12-10-24(11-13-25)15-16-2-3-16/h4,9,14,16,18-19H,2-3,5-8,10-13,15H2,1H3,(H,23,27)