8-[3-(aminomethyl)-4-[(phenylmethyl)amino]pyrrolidin-1-yl]-1-cyclopropyl-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 8-[3-(aminomethyl)-4-[(phenylmethyl)amino]pyrrolidin-1-yl]-1-cyclopropyl-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 8-[3-(aminomethyl)-4-(benzylamino)pyrrolidin-1-yl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxo-quinolizine-3-carboxylic acid CAS Name: 8-[3-(aminomethyl)-4-[(phenylmethyl)amino]-1-pyrrolidinyl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 8-[3-(aminomethyl)-4-(benzylamino)pyrrolidin-1-yl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxoquinolizine-3-carboxylic acid Traditional Name: 8-[3-(aminomethyl)-4-(benzylamino)pyrrolidino]-1-cyclopropyl-7-fluoro-4-keto-9-methyl-quinolizine-3-carboxylic acid Formula: C26H29FN4O3 MolecularWeight: 464.531863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)F)N4CC(C(C4)NCC5=CC=CC=C5)CN

Isomeric SMILES

CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)F)N4CC(C(C4)NCC5=CC=CC=C5)CN

InChI

InChI=1S/C26H29FN4O3/c1-15-23-19(17-7-8-17)9-20(26(33)34)25(32)31(23)13-21(27)24(15)30-12-18(10-28)22(14-30)29-11-16-5-3-2-4-6-16/h2-6,9,13,17-18,22,29H,7-8,10-12,14,28H2,1H3,(H,33,34)