4-[(3-cyanophenyl)methyl-methoxycarbonyl-amino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid

Systemtic Name: 4-[(3-cyanophenyl)methyl-methoxycarbonyl-amino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid Openeye Name: 4-[(3-cyanophenyl)methyl-methoxycarbonyl-amino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid CAS Name: 4-[(3-cyanophenyl)methyl-methoxycarbonylamino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid IUPAC Name: 4-[(3-cyanophenyl)methyl-methoxycarbonylamino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid Traditional Name: 4-[carbomethoxy-(3-cyanobenzyl)amino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid Formula: C23H25N3O6 MolecularWeight: 439.4611

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=CC(=C(C=C2N1C(=O)O)OC)OC)N(CC3=CC=CC(=C3)C#N)C(=O)OC

Isomeric SMILES

CC1CC(C2=CC(=C(C=C2N1C(=O)O)OC)OC)N(CC3=CC=CC(=C3)C#N)C(=O)OC

InChI

InChI=1S/C23H25N3O6/c1-14-8-18(25(23(29)32-4)13-16-7-5-6-15(9-16)12-24)17-10-20(30-2)21(31-3)11-19(17)26(14)22(27)28/h5-7,9-11,14,18H,8,13H2,1-4H3,(H,27,28)