2-methyl-7-[[(4-methyl-2-nitro-phenyl)amino]-thiophen-2-yl-methyl]quinolin-8-ol

Systemtic Name: 2-methyl-7-[[(4-methyl-2-nitro-phenyl)amino]-thiophen-2-yl-methyl]quinolin-8-ol Openeye Name: 2-methyl-7-[(4-methyl-2-nitro-anilino)-(2-thienyl)methyl]quinolin-8-ol CAS Name: 2-methyl-7-[(4-methyl-2-nitroanilino)-thiophen-2-ylmethyl]-8-quinolinol IUPAC Name: 2-methyl-7-[(4-methyl-2-nitroanilino)-thiophen-2-ylmethyl]quinolin-8-ol Traditional Name: 2-methyl-7-[(4-methyl-2-nitro-anilino)-(2-thienyl)methyl]quinolin-8-ol Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(C2=C(C3=C(C=CC(=N3)C)C=C2)O)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(C2=C(C3=C(C=CC(=N3)C)C=C2)O)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O3S/c1-13-5-10-17(18(12-13)25(27)28)24-21(19-4-3-11-29-19)16-9-8-15-7-6-14(2)23-20(15)22(16)26/h3-12,21,24,26H,1-2H3