N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]-4-oxidanylidene-chromene-2-carboxamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]-4-oxo-chromene-2-carboxamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]-4-oxochromene-2-carboxamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]-4-keto-chromene-2-carboxamide Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)CCCNC(=O)C3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)CCCNC(=O)C3=CC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C22H22N2O5S/c25-19-14-21(29-20-9-4-3-8-18(19)20)22(26)23-11-5-13-30(27,28)24-12-10-16-6-1-2-7-17(16)15-24/h1-4,6-9,14H,5,10-13,15H2,(H,23,26)