4-[1-[(7-carbamimidoylnaphthalen-2-yl)methyl]-2-oxidanylidene-quinolin-6-yl]oxypiperidine-1-carboximidamide

Systemtic Name: 4-[1-[(7-carbamimidoylnaphthalen-2-yl)methyl]-2-oxidanylidene-quinolin-6-yl]oxypiperidine-1-carboximidamide Openeye Name: 4-[[1-[(7-carbamimidoyl-2-naphthyl)methyl]-2-oxo-6-quinolyl]oxy]piperidine-1-carboxamidine CAS Name: 4-[[1-[(7-carbamimidoyl-2-naphthalenyl)methyl]-2-oxo-6-quinolinyl]oxy]-1-piperidinecarboximidamide IUPAC Name: 4-[1-[(7-carbamimidoylnaphthalen-2-yl)methyl]-2-oxoquinolin-6-yl]oxypiperidine-1-carboximidamide Traditional Name: 4-[[1-[(7-amidino-2-naphthyl)methyl]-2-keto-6-quinolyl]oxy]piperidine-1-carboxamidine Formula: C27H28N6O2 MolecularWeight: 468.55022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC3=C(C=C2)N(C(=O)C=C3)CC4=CC5=C(C=C4)C=CC(=C5)C(=N)N)C(=N)N

Isomeric SMILES

C1CN(CCC1OC2=CC3=C(C=C2)N(C(=O)C=C3)CC4=CC5=C(C=C4)C=CC(=C5)C(=N)N)C(=N)N

InChI

InChI=1S/C27H28N6O2/c28-26(29)20-4-3-18-2-1-17(13-21(18)14-20)16-33-24-7-6-23(15-19(24)5-8-25(33)34)35-22-9-11-32(12-10-22)27(30)31/h1-8,13-15,22H,9-12,16H2,(H3,28,29)(H3,30,31)