2-[4-(diphenylmethyl)piperazin-1-yl]-1-[4-(ethylamino)-3-nitro-phenyl]ethanol

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]-1-[4-(ethylamino)-3-nitro-phenyl]ethanol Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)-1-[4-(ethylamino)-3-nitro-phenyl]ethanol CAS Name: 2-[4-(diphenylmethyl)-1-piperazinyl]-1-[4-(ethylamino)-3-nitrophenyl]ethanol IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)-1-[4-(ethylamino)-3-nitrophenyl]ethanol Traditional Name: 2-(4-benzhydrylpiperazino)-1-[4-(ethylamino)-3-nitro-phenyl]ethanol Formula: C27H32N4O3 MolecularWeight: 460.56798

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)C(CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C(C=C1)C(CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O)[N+](=O)[O-]

InChI

InChI=1S/C27H32N4O3/c1-2-28-24-14-13-23(19-25(24)31(33)34)26(32)20-29-15-17-30(18-16-29)27(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-14,19,26-28,32H,2,15-18,20H2,1H3