4-[3-(aminomethyl)pyrrolidin-1-yl]-6-cyclopropyl-9-oxidanylidene-3H-imidazo[4,5-f]quinoline-8-carboxylic acid

Systemtic Name: 4-[3-(aminomethyl)pyrrolidin-1-yl]-6-cyclopropyl-9-oxidanylidene-3H-imidazo[4,5-f]quinoline-8-carboxylic acid Openeye Name: 4-[3-(aminomethyl)pyrrolidin-1-yl]-6-cyclopropyl-9-oxo-3H-imidazo[4,5-f]quinoline-8-carboxylic acid CAS Name: 4-[3-(aminomethyl)-1-pyrrolidinyl]-6-cyclopropyl-9-oxo-3H-imidazo[4,5-f]quinoline-8-carboxylic acid IUPAC Name: 4-[3-(aminomethyl)pyrrolidin-1-yl]-6-cyclopropyl-9-oxo-3H-imidazo[4,5-f]quinoline-8-carboxylic acid Traditional Name: 4-[3-(aminomethyl)pyrrolidino]-6-cyclopropyl-9-keto-3H-imidazo[4,5-f]quinoline-8-carboxylic acid Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=C4C(=C(C=C32)N5CCC(C5)CN)NC=N4)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=C4C(=C(C=C32)N5CCC(C5)CN)NC=N4)C(=O)O

InChI

InChI=1S/C19H21N5O3/c20-6-10-3-4-23(7-10)14-5-13-15(17-16(14)21-9-22-17)18(25)12(19(26)27)8-24(13)11-1-2-11/h5,8-11H,1-4,6-7,20H2,(H,21,22)(H,26,27)