3-(4-methoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(4-methoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(4-methoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(4-methoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(4-methoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(4-methoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propionamide Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O4S/c1-24-13-6-2-11(3-7-13)4-9-16(21)19-17-18-14-8-5-12(20(22)23)10-15(14)25-17/h2-3,5-8,10H,4,9H2,1H3,(H,18,19,21)