4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-6,7,8,9-tetrahydrobenzo[g]chromen-2-one

Systemtic Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-6,7,8,9-tetrahydrobenzo[g]chromen-2-one Openeye Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-6,7,8,9-tetrahydrobenzo[g]chromen-2-one CAS Name: 4-[(4-phenyl-1-piperazin-1-iumyl)methyl]-6,7,8,9-tetrahydrobenzo[g][1]benzopyran-2-one IUPAC Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-6,7,8,9-tetrahydrobenzo[g]chromen-2-one Traditional Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-6,7,8,9-tetrahydrobenzo[g]chromen-2-one Formula: C24H27N2O2+ MolecularWeight: 375.48338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C3C(=CC(=O)OC3=C2)C[NH+]4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CCC2=C(C1)C=C3C(=CC(=O)OC3=C2)C[NH+]4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C24H26N2O2/c27-24-16-20(22-14-18-6-4-5-7-19(18)15-23(22)28-24)17-25-10-12-26(13-11-25)21-8-2-1-3-9-21/h1-3,8-9,14-16H,4-7,10-13,17H2/p+1