(2-methoxy-3-methyl-phenyl)-[4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]methanone

Systemtic Name: (2-methoxy-3-methyl-phenyl)-[4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]methanone Openeye Name: (2-methoxy-3-methyl-phenyl)-[4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]methanone CAS Name: (2-methoxy-3-methylphenyl)-[4-[4-nitro-3-(phenethylamino)phenyl]-1-piperazinyl]methanone IUPAC Name: (2-methoxy-3-methylphenyl)-[4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]methanone Traditional Name: (2-methoxy-3-methyl-phenyl)-[4-[4-nitro-3-(phenethylamino)phenyl]piperazino]methanone Formula: C27H30N4O4 MolecularWeight: 474.5515

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NCCC4=CC=CC=C4

InChI

InChI=1S/C27H30N4O4/c1-20-7-6-10-23(26(20)35-2)27(32)30-17-15-29(16-18-30)22-11-12-25(31(33)34)24(19-22)28-14-13-21-8-4-3-5-9-21/h3-12,19,28H,13-18H2,1-2H3