3-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-6-methoxy-1H-quinolin-2-one

Systemtic Name: 3-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-6-methoxy-1H-quinolin-2-one Openeye Name: 3-[(1-cyclohexyltetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-6-methoxy-1H-quinolin-2-one CAS Name: 3-[(1-cyclohexyl-5-tetrazolyl)-(4-phenyl-1-piperazinyl)methyl]-6-methoxy-1H-quinolin-2-one IUPAC Name: 3-[(1-cyclohexyltetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-6-methoxy-1H-quinolin-2-one Traditional Name: 3-[(1-cyclohexyltetrazol-5-yl)-(4-phenylpiperazino)methyl]-6-methoxy-carbostyril Formula: C28H33N7O2 MolecularWeight: 499.60732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C4CCCCC4)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C4CCCCC4)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C28H33N7O2/c1-37-23-12-13-25-20(18-23)19-24(28(36)29-25)26(27-30-31-32-35(27)22-10-6-3-7-11-22)34-16-14-33(15-17-34)21-8-4-2-5-9-21/h2,4-5,8-9,12-13,18-19,22,26H,3,6-7,10-11,14-17H2,1H3,(H,29,36)