methyl 2-[2-(3-methoxynaphthalen-2-yl)carbonylimino-6-nitro-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(3-methoxynaphthalen-2-yl)carbonylimino-6-nitro-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(3-methoxynaphthalene-2-carbonyl)imino-6-nitro-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(3-methoxy-2-naphthalenyl)-oxomethyl]imino-6-nitro-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3-methoxynaphthalene-2-carbonyl)imino-6-nitro-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(3-methoxy-2-naphthoyl)imino-6-nitro-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C22H17N3O6S MolecularWeight: 451.45188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)N=C3N(C4=C(S3)C=C(C=C4)[N+](=O)[O-])CC(=O)OC

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)N=C3N(C4=C(S3)C=C(C=C4)[N+](=O)[O-])CC(=O)OC

InChI

InChI=1S/C22H17N3O6S/c1-30-18-10-14-6-4-3-5-13(14)9-16(18)21(27)23-22-24(12-20(26)31-2)17-8-7-15(25(28)29)11-19(17)32-22/h3-11H,12H2,1-2H3