2-[3-(3-methylphenoxy)propylamino]-5-nitro-benzenesulfonamide

Systemtic Name: 2-[3-(3-methylphenoxy)propylamino]-5-nitro-benzenesulfonamide Openeye Name: 2-[3-(3-methylphenoxy)propylamino]-5-nitro-benzenesulfonamide CAS Name: 2-[3-(3-methylphenoxy)propylamino]-5-nitrobenzenesulfonamide IUPAC Name: 2-[3-(3-methylphenoxy)propylamino]-5-nitrobenzenesulfonamide Traditional Name: 2-[3-(3-methylphenoxy)propylamino]-5-nitro-benzenesulfonamide Formula: C16H19N3O5S MolecularWeight: 365.40416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)OCCCNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C16H19N3O5S/c1-12-4-2-5-14(10-12)24-9-3-8-18-15-7-6-13(19(20)21)11-16(15)25(17,22)23/h2,4-7,10-11,18H,3,8-9H2,1H3,(H2,17,22,23)