2-methoxy-7-[[4-(phenylmethyl)piperazin-1-yl]methyl]-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-methoxy-7-[[4-(phenylmethyl)piperazin-1-yl]methyl]-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 7-[(4-benzylpiperazin-1-yl)methyl]-4-isopropyl-2-methoxy-cyclohepta-2,4,6-trien-1-one CAS Name: 2-methoxy-7-[[4-(phenylmethyl)-1-piperazinyl]methyl]-4-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-[(4-benzylpiperazin-1-yl)methyl]-2-methoxy-4-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 7-[(4-benzylpiperazino)methyl]-4-isopropyl-2-methoxy-cyclohepta-2,4,6-trien-1-one Formula: C23H30N2O2 MolecularWeight: 366.4965

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C(=O)C(=C1)OC)CN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C(=O)C(=C1)OC)CN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O2/c1-18(2)20-9-10-21(23(26)22(15-20)27-3)17-25-13-11-24(12-14-25)16-19-7-5-4-6-8-19/h4-10,15,18H,11-14,16-17H2,1-3H3