[3-chloranyl-5-methoxy-4-(3-methylbutoxy)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [3-chloranyl-5-methoxy-4-(3-methylbutoxy)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (3-chloro-4-isopentyloxy-5-methoxy-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [3-chloro-5-methoxy-4-(3-methylbutoxy)phenyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [3-chloro-5-methoxy-4-(3-methylbutoxy)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (3-chloro-4-isoamoxy-5-methoxy-phenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C23H28ClN3O5 MolecularWeight: 461.93852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C23H28ClN3O5/c1-16(2)8-13-32-22-20(24)14-17(15-21(22)31-3)23(28)26-11-9-25(10-12-26)18-4-6-19(7-5-18)27(29)30/h4-7,14-16H,8-13H2,1-3H3