2-(3,4-dihydro-2H-quinolin-1-ylamino)-3-naphthalen-1-ylsulfonyl-3-oxidanylidene-propanoic acid

Systemtic Name: 2-(3,4-dihydro-2H-quinolin-1-ylamino)-3-naphthalen-1-ylsulfonyl-3-oxidanylidene-propanoic acid Openeye Name: 2-(3,4-dihydro-2H-quinolin-1-ylamino)-3-(1-naphthylsulfonyl)-3-oxo-propanoic acid CAS Name: 2-(3,4-dihydro-2H-quinolin-1-ylamino)-3-(1-naphthalenylsulfonyl)-3-oxopropanoic acid IUPAC Name: 2-(3,4-dihydro-2H-quinolin-1-ylamino)-3-naphthalen-1-ylsulfonyl-3-oxopropanoic acid Traditional Name: 2-(3,4-dihydro-2H-quinolin-1-ylamino)-3-keto-3-(1-naphthylsulfonyl)propionic acid Formula: C22H20N2O5S MolecularWeight: 424.4696

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)NC(C(=O)O)C(=O)S(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)NC(C(=O)O)C(=O)S(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H20N2O5S/c25-21(26)20(23-24-14-6-10-16-8-2-4-12-18(16)24)22(27)30(28,29)19-13-5-9-15-7-1-3-11-17(15)19/h1-5,7-9,11-13,20,23H,6,10,14H2,(H,25,26)