3-[4-(6-butoxy-2-methoxy-cyclohexa-1,3-dien-1-yl)piperazin-1-yl]-6-chloranyl-1H-indazole

Systemtic Name: 3-[4-(6-butoxy-2-methoxy-cyclohexa-1,3-dien-1-yl)piperazin-1-yl]-6-chloranyl-1H-indazole Openeye Name: 3-[4-(6-butoxy-2-methoxy-cyclohexa-1,3-dien-1-yl)piperazin-1-yl]-6-chloro-1H-indazole CAS Name: 3-[4-(6-butoxy-2-methoxy-1-cyclohexa-1,3-dienyl)-1-piperazinyl]-6-chloro-1H-indazole IUPAC Name: 3-[4-(6-butoxy-2-methoxycyclohexa-1,3-dien-1-yl)piperazin-1-yl]-6-chloro-1H-indazole Traditional Name: 3-[4-(6-butoxy-2-methoxy-cyclohexa-1,3-dien-1-yl)piperazino]-6-chloro-1H-indazole Formula: C22H29ClN4O2 MolecularWeight: 416.94426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1CC=CC(=C1N2CCN(CC2)C3=NNC4=C3C=CC(=C4)Cl)OC

Isomeric SMILES

CCCCOC1CC=CC(=C1N2CCN(CC2)C3=NNC4=C3C=CC(=C4)Cl)OC

InChI

InChI=1S/C22H29ClN4O2/c1-3-4-14-29-20-7-5-6-19(28-2)21(20)26-10-12-27(13-11-26)22-17-9-8-16(23)15-18(17)24-25-22/h5-6,8-9,15,20H,3-4,7,10-14H2,1-2H3,(H,24,25)