7-[(4-phenylpiperazin-1-yl)methyl]-4-propan-2-yl-2-(propylamino)cyclohepta-2,4,6-trien-1-one

Systemtic Name: 7-[(4-phenylpiperazin-1-yl)methyl]-4-propan-2-yl-2-(propylamino)cyclohepta-2,4,6-trien-1-one Openeye Name: 4-isopropyl-7-[(4-phenylpiperazin-1-yl)methyl]-2-(propylamino)cyclohepta-2,4,6-trien-1-one CAS Name: 7-[(4-phenyl-1-piperazinyl)methyl]-4-propan-2-yl-2-(propylamino)-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-[(4-phenylpiperazin-1-yl)methyl]-4-propan-2-yl-2-(propylamino)cyclohepta-2,4,6-trien-1-one Traditional Name: 4-isopropyl-7-[(4-phenylpiperazino)methyl]-2-(propylamino)cyclohepta-2,4,6-trien-1-one Formula: C24H33N3O MolecularWeight: 379.53832

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=CC(=CC=C(C1=O)CN2CCN(CC2)C3=CC=CC=C3)C(C)C

Isomeric SMILES

CCCNC1=CC(=CC=C(C1=O)CN2CCN(CC2)C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C24H33N3O/c1-4-12-25-23-17-20(19(2)3)10-11-21(24(23)28)18-26-13-15-27(16-14-26)22-8-6-5-7-9-22/h5-11,17,19H,4,12-16,18H2,1-3H3,(H,25,28)