N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide

Systemtic Name: N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide Openeye Name: N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide CAS Name: N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide IUPAC Name: N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]propionamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)CCN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)CCN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C20H21N3O4S/c1-14(15-6-5-7-16(12-15)23(26)27)21(2)19(24)10-11-22-17-8-3-4-9-18(17)28-13-20(22)25/h3-9,12,14H,10-11,13H2,1-2H3/t14-/m1/s1