methyl 2-[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]carbamoylamino]-6-nitro-benzoate

Systemtic Name: methyl 2-[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]carbamoylamino]-6-nitro-benzoate Openeye Name: methyl 2-[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]carbamoylamino]-6-nitro-benzoate CAS Name: 2-[[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)anilino]-oxomethyl]amino]-6-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]carbamoylamino]-6-nitrobenzoate Traditional Name: 2-[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]carbamoylamino]-6-nitro-benzoic acid methyl ester Formula: C24H22N4O7S MolecularWeight: 510.51908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1[N+](=O)[O-])NC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1=C(C=CC=C1[N+](=O)[O-])NC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C24H22N4O7S/c1-35-23(29)22-19(11-5-13-21(22)28(31)32)26-24(30)25-17-9-4-10-18(15-17)36(33,34)27-14-6-8-16-7-2-3-12-20(16)27/h2-5,7,9-13,15H,6,8,14H2,1H3,(H2,25,26,30)