N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)propanamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)propanamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)propionamide Formula: C26H30N2O6S MolecularWeight: 498.5912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C26H30N2O6S/c1-18-22-12-9-20(33-2)17-24(22)34-26(30)23(18)13-14-25(29)27-19-7-10-21(11-8-19)35(31,32)28-15-5-3-4-6-16-28/h7-12,17H,3-6,13-16H2,1-2H3,(H,27,29)