10-chloranyl-N-(4-heptoxyphenyl)-4-oxidanylidene-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-2-carboxamide

Systemtic Name: 10-chloranyl-N-(4-heptoxyphenyl)-4-oxidanylidene-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-2-carboxamide Openeye Name: 10-chloro-N-(4-heptoxyphenyl)-4-oxo-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-2-carboxamide CAS Name: 10-chloro-N-(4-heptoxyphenyl)-4-oxo-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-2-carboxamide IUPAC Name: 10-chloro-N-(4-heptoxyphenyl)-4-oxo-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-2-carboxamide Traditional Name: 10-chloro-N-(4-heptoxyphenyl)-4-keto-3,6,7,11b-tetrahydro-1H-pyrazin[2,1-a]isoquinoline-2-carboxamide Formula: C26H32ClN3O3 MolecularWeight: 470.00358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)NC(=O)N2CC3C4=C(CCN3C(=O)C2)C=CC(=C4)Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)NC(=O)N2CC3C4=C(CCN3C(=O)C2)C=CC(=C4)Cl

InChI

InChI=1S/C26H32ClN3O3/c1-2-3-4-5-6-15-33-22-11-9-21(10-12-22)28-26(32)29-17-24-23-16-20(27)8-7-19(23)13-14-30(24)25(31)18-29/h7-12,16,24H,2-6,13-15,17-18H2,1H3,(H,28,32)