6-methoxy-4-(4-methylcyclohexa-1,3-dien-1-yl)oxy-7-(4-piperazin-1-ylbutoxy)quinoline

Systemtic Name: 6-methoxy-4-(4-methylcyclohexa-1,3-dien-1-yl)oxy-7-(4-piperazin-1-ylbutoxy)quinoline Openeye Name: 6-methoxy-4-(4-methylcyclohexa-1,3-dien-1-yl)oxy-7-(4-piperazin-1-ylbutoxy)quinoline CAS Name: 6-methoxy-4-[(4-methyl-1-cyclohexa-1,3-dienyl)oxy]-7-[4-(1-piperazinyl)butoxy]quinoline IUPAC Name: 6-methoxy-4-(4-methylcyclohexa-1,3-dien-1-yl)oxy-7-(4-piperazin-1-ylbutoxy)quinoline Traditional Name: 6-methoxy-4-(4-methylcyclohexa-1,3-dien-1-yl)oxy-7-(4-piperazinobutoxy)quinoline Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(CC1)OC2=C3C=C(C(=CC3=NC=C2)OCCCCN4CCNCC4)OC

Isomeric SMILES

CC1=CC=C(CC1)OC2=C3C=C(C(=CC3=NC=C2)OCCCCN4CCNCC4)OC

InChI

InChI=1S/C25H33N3O3/c1-19-5-7-20(8-6-19)31-23-9-10-27-22-18-25(24(29-2)17-21(22)23)30-16-4-3-13-28-14-11-26-12-15-28/h5,7,9-10,17-18,26H,3-4,6,8,11-16H2,1-2H3