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

Systemtic Name: 3-[(4-cyclohexylpiperazin-1-yl)-(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl]-6-methoxy-1H-quinolin-2-one Openeye Name: 3-[(4-cyclohexylpiperazin-1-yl)-(1-phenethyltetrazol-5-yl)methyl]-6-methoxy-1H-quinolin-2-one CAS Name: 3-[(4-cyclohexyl-1-piperazinyl)-(1-phenethyl-5-tetrazolyl)methyl]-6-methoxy-1H-quinolin-2-one IUPAC Name: 3-[(4-cyclohexylpiperazin-1-yl)-(1-phenethyltetrazol-5-yl)methyl]-6-methoxy-1H-quinolin-2-one Traditional Name: 3-[(4-cyclohexylpiperazino)-(1-phenethyltetrazol-5-yl)methyl]-6-methoxy-carbostyril Formula: C30H37N7O2 MolecularWeight: 527.66048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3CCC4=CC=CC=C4)N5CCN(CC5)C6CCCCC6

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3CCC4=CC=CC=C4)N5CCN(CC5)C6CCCCC6

InChI

InChI=1S/C30H37N7O2/c1-39-25-12-13-27-23(20-25)21-26(30(38)31-27)28(36-18-16-35(17-19-36)24-10-6-3-7-11-24)29-32-33-34-37(29)15-14-22-8-4-2-5-9-22/h2,4-5,8-9,12-13,20-21,24,28H,3,6-7,10-11,14-19H2,1H3,(H,31,38)