7-[3-(aminomethyl)pyrrolidin-1-yl]-6-bromanyl-5-methyl-4-oxidanylidene-1H-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-6-bromanyl-5-methyl-4-oxidanylidene-1H-1,8-naphthyridine-3-carboxylic acid Openeye Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-6-bromo-5-methyl-4-oxo-1H-1,8-naphthyridine-3-carboxylic acid CAS Name: 7-[3-(aminomethyl)-1-pyrrolidinyl]-6-bromo-5-methyl-4-oxo-1H-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-6-bromo-5-methyl-4-oxo-1H-1,8-naphthyridine-3-carboxylic acid Traditional Name: 7-[3-(aminomethyl)pyrrolidino]-6-bromo-4-keto-5-methyl-1H-1,8-naphthyridine-3-carboxylic acid Formula: C15H17BrN4O3 MolecularWeight: 381.22448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=O)C(=CNC2=NC(=C1Br)N3CCC(C3)CN)C(=O)O

Isomeric SMILES

CC1=C2C(=O)C(=CNC2=NC(=C1Br)N3CCC(C3)CN)C(=O)O

InChI

InChI=1S/C15H17BrN4O3/c1-7-10-12(21)9(15(22)23)5-18-13(10)19-14(11(7)16)20-3-2-8(4-17)6-20/h5,8H,2-4,6,17H2,1H3,(H,22,23)(H,18,19,21)