[3-bromanyl-4-(3-methylbutoxy)phenyl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [3-bromanyl-4-(3-methylbutoxy)phenyl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-(3-bromo-4-isopentyloxy-phenyl)methanone CAS Name: [3-bromo-4-(3-methylbutoxy)phenyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[3-bromo-4-(3-methylbutoxy)phenyl]methanone Traditional Name: (4-benzylpiperazino)-(3-bromo-4-isoamoxy-phenyl)methanone Formula: C23H29BrN2O2 MolecularWeight: 445.39256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)Br

InChI

InChI=1S/C23H29BrN2O2/c1-18(2)10-15-28-22-9-8-20(16-21(22)24)23(27)26-13-11-25(12-14-26)17-19-6-4-3-5-7-19/h3-9,16,18H,10-15,17H2,1-2H3