N-(3-methoxypropyl)-2-[(4-nitrophenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-(3-methoxypropyl)-2-[(4-nitrophenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-nitro-anilino]-N-(3-methoxypropyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-nitroanilino]-N-(3-methoxypropyl)acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-nitroanilino]-N-(3-methoxypropyl)acetamide Traditional Name: 2-(N-besyl-4-nitro-anilino)-N-(3-methoxypropyl)acetamide Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CN(C1=CC=C(C=C1)[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COCCCNC(=O)CN(C1=CC=C(C=C1)[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H21N3O6S/c1-27-13-5-12-19-18(22)14-20(15-8-10-16(11-9-15)21(23)24)28(25,26)17-6-3-2-4-7-17/h2-4,6-11H,5,12-14H2,1H3,(H,19,22)