N-[3-(4-ethylpiperazin-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxo-isoquinoline-4-carboxamide CAS Name: N-[3-(4-ethyl-1-piperazinyl)propyl]-6,7-dimethoxy-2-methyl-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxoisoquinoline-4-carboxamide Traditional Name: N-[3-(4-ethylpiperazino)propyl]-1-keto-6,7-dimethoxy-2-methyl-isoquinoline-4-carboxamide Formula: C22H32N4O4 MolecularWeight: 416.51388

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCNC(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)C

Isomeric SMILES

CCN1CCN(CC1)CCCNC(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)C

InChI

InChI=1S/C22H32N4O4/c1-5-25-9-11-26(12-10-25)8-6-7-23-21(27)18-15-24(2)22(28)17-14-20(30-4)19(29-3)13-16(17)18/h13-15H,5-12H2,1-4H3,(H,23,27)