3-(2-ethylpiperidin-1-yl)carbonyl-4-(4-methylphenyl)isochromen-1-one

Systemtic Name: 3-(2-ethylpiperidin-1-yl)carbonyl-4-(4-methylphenyl)isochromen-1-one Openeye Name: 3-(2-ethylpiperidine-1-carbonyl)-4-(p-tolyl)isochromen-1-one CAS Name: 3-[(2-ethyl-1-piperidinyl)-oxomethyl]-4-(4-methylphenyl)-2-benzopyran-1-one IUPAC Name: 3-(2-ethylpiperidine-1-carbonyl)-4-(4-methylphenyl)isochromen-1-one Traditional Name: 3-(2-ethylpiperidine-1-carbonyl)-4-(p-tolyl)isocoumarin Formula: C24H25NO3 MolecularWeight: 375.4602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C2=C(C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1CCCCN1C(=O)C2=C(C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H25NO3/c1-3-18-8-6-7-15-25(18)23(26)22-21(17-13-11-16(2)12-14-17)19-9-4-5-10-20(19)24(27)28-22/h4-5,9-14,18H,3,6-8,15H2,1-2H3