7-methyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-6-propan-2-yl-chromen-2-one

Systemtic Name: 7-methyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-6-propan-2-yl-chromen-2-one Openeye Name: 6-isopropyl-7-methyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]chromen-2-one CAS Name: 7-methyl-4-[(4-phenyl-1-piperazin-1-iumyl)methyl]-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-6-propan-2-ylchromen-2-one Traditional Name: 6-isopropyl-7-methyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]coumarin Formula: C24H29N2O2+ MolecularWeight: 377.49926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+]3CCN(CC3)C4=CC=CC=C4)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+]3CCN(CC3)C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C24H28N2O2/c1-17(2)21-15-22-19(14-24(27)28-23(22)13-18(21)3)16-25-9-11-26(12-10-25)20-7-5-4-6-8-20/h4-8,13-15,17H,9-12,16H2,1-3H3/p+1