methyl 9-cyclopentyloxy-3-methyl-7-oxidanylidene-2,3,4,5-tetrahydro-1H-pyrido[1,2-d][1,4]diazepin-3-ium-10-carboxylate

Systemtic Name: methyl 9-cyclopentyloxy-3-methyl-7-oxidanylidene-2,3,4,5-tetrahydro-1H-pyrido[1,2-d][1,4]diazepin-3-ium-10-carboxylate Openeye Name: methyl 9-(cyclopentoxy)-3-methyl-7-oxo-2,3,4,5-tetrahydro-1H-pyrido[1,2-d][1,4]diazepin-3-ium-10-carboxylate CAS Name: 9-cyclopentyloxy-3-methyl-7-oxo-2,3,4,5-tetrahydro-1H-pyrido[1,2-d][1,4]diazepin-3-ium-10-carboxylic acid methyl ester IUPAC Name: methyl 9-cyclopentyloxy-3-methyl-7-oxo-2,3,4,5-tetrahydro-1H-pyrido[1,2-d][1,4]diazepin-3-ium-10-carboxylate Traditional Name: 9-(cyclopentoxy)-7-keto-3-methyl-2,3,4,5-tetrahydro-1H-pyrido[1,2-d][1,4]diazepin-3-ium-10-carboxylic acid methyl ester Formula: C17H25N2O4+ MolecularWeight: 321.3914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C(=CC(=O)N2CC1)OC3CCCC3)C(=O)OC

Isomeric SMILES

C[NH+]1CCC2=C(C(=CC(=O)N2CC1)OC3CCCC3)C(=O)OC

InChI

InChI=1S/C17H24N2O4/c1-18-8-7-13-16(17(21)22-2)14(23-12-5-3-4-6-12)11-15(20)19(13)10-9-18/h11-12H,3-10H2,1-2H3/p+1