2-cyclopropyl-3-(3-methylphenyl)-N-(3-morpholin-4-ylpropyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-cyclopropyl-3-(3-methylphenyl)-N-(3-morpholin-4-ylpropyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-cyclopropyl-N-(3-morpholinopropyl)-3-(m-tolyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-cyclopropyl-3-(3-methylphenyl)-N-[3-(4-morpholinyl)propyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-cyclopropyl-3-(3-methylphenyl)-N-(3-morpholin-4-ylpropyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-cyclopropyl-1-keto-N-(3-morpholinopropyl)-3-(m-tolyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCCCN5CCOCC5

Isomeric SMILES

CC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCCCN5CCOCC5

InChI

InChI=1S/C27H33N3O3/c1-19-6-4-7-20(18-19)25-24(26(31)28-12-5-13-29-14-16-33-17-15-29)22-8-2-3-9-23(22)27(32)30(25)21-10-11-21/h2-4,6-9,18,21,24-25H,5,10-17H2,1H3,(H,28,31)