1-(2-azanyl-6-methyl-3-oxidanyl-phenyl)-3-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 1-(2-azanyl-6-methyl-3-oxidanyl-phenyl)-3-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(2-amino-3-hydroxy-6-methyl-phenyl)-3-(4-benzhydrylpiperazin-1-yl)propan-1-one CAS Name: 1-(2-amino-3-hydroxy-6-methylphenyl)-3-[4-(diphenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(2-amino-3-hydroxy-6-methylphenyl)-3-(4-benzhydrylpiperazin-1-yl)propan-1-one Traditional Name: 1-(2-amino-3-hydroxy-6-methyl-phenyl)-3-(4-benzhydrylpiperazino)propan-1-one Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)O)N)C(=O)CCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(C=C1)O)N)C(=O)CCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2/c1-20-12-13-24(32)26(28)25(20)23(31)14-15-29-16-18-30(19-17-29)27(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-13,27,32H,14-19,28H2,1H3