4-(1-aminocarbonylpiperidin-4-yl)piperidine-1-carboxamide; 2-[(1-azanylisoquinolin-7-yl)carbonyl-naphthalen-1-yl-amino]ethanoic acid

Systemtic Name: 4-(1-aminocarbonylpiperidin-4-yl)piperidine-1-carboxamide; 2-[(1-azanylisoquinolin-7-yl)carbonyl-naphthalen-1-yl-amino]ethanoic acid Openeye Name: 2-[(1-aminoisoquinoline-7-carbonyl)-(1-naphthyl)amino]acetic acid; 4-(1-carbamoyl-4-piperidyl)piperidine-1-carboxamide CAS Name: 2-[[(1-amino-7-isoquinolinyl)-oxomethyl]-(1-naphthalenyl)amino]acetic acid; 4-(1-carbamoyl-4-piperidinyl)-1-piperidinecarboxamide IUPAC Name: 2-[(1-aminoisoquinoline-7-carbonyl)-naphthalen-1-ylamino]acetic acid; 4-(1-carbamoylpiperidin-4-yl)piperidine-1-carboxamide Traditional Name: 2-[(1-aminoisoquinoline-7-carbonyl)-(1-naphthyl)amino]acetic acid; 4-(1-carbamoyl-4-piperidyl)piperidine-1-carboxamide Formula: C34H39N7O5 MolecularWeight: 625.71736

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2CCN(CC2)C(=O)N)C(=O)N.C1=CC=C2C(=C1)C=CC=C2N(CC(=O)O)C(=O)C3=CC4=C(C=C3)C=CN=C4N

Isomeric SMILES

C1CN(CCC1C2CCN(CC2)C(=O)N)C(=O)N.C1=CC=C2C(=C1)C=CC=C2N(CC(=O)O)C(=O)C3=CC4=C(C=C3)C=CN=C4N

InChI

InChI=1S/C22H17N3O3.C12H22N4O2/c23-21-18-12-16(9-8-15(18)10-11-24-21)22(28)25(13-20(26)27)19-7-3-5-14-4-1-2-6-17(14)19;13-11(17)15-5-1-9(2-6-15)10-3-7-16(8-4-10)12(14)18/h1-12H,13H2,(H2,23,24)(H,26,27);9-10H,1-8H2,(H2,13,17)(H2,14,18)