6-methyl-8,9-dihydro-7H-pyrido[3,2-c]azepin-5-one; 2-oxidanylidene-2-(2-piperazin-1-ylethoxy)ethanoic acid

Systemtic Name: 6-methyl-8,9-dihydro-7H-pyrido[3,2-c]azepin-5-one; 2-oxidanylidene-2-(2-piperazin-1-ylethoxy)ethanoic acid Openeye Name: 6-methyl-8,9-dihydro-7H-pyrido[3,2-c]azepin-5-one; 2-oxo-2-(2-piperazin-1-ylethoxy)acetic acid CAS Name: 6-methyl-8,9-dihydro-7H-pyrido[3,2-c]azepin-5-one; 2-oxo-2-[2-(1-piperazinyl)ethoxy]acetic acid IUPAC Name: 6-methyl-8,9-dihydro-7H-pyrido[3,2-c]azepin-5-one; 2-oxo-2-(2-piperazin-1-ylethoxy)acetic acid Traditional Name: 2-keto-2-(2-piperazinoethoxy)acetic acid; 6-methyl-8,9-dihydro-7H-pyrid[3,2-c]azepin-5-one Formula: C18H26N4O5 MolecularWeight: 378.42284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC2=C(C1=O)C=CC=N2.C1CN(CCN1)CCOC(=O)C(=O)O

Isomeric SMILES

CN1CCCC2=C(C1=O)C=CC=N2.C1CN(CCN1)CCOC(=O)C(=O)O

InChI

InChI=1S/C10H12N2O.C8H14N2O4/c1-12-7-3-5-9-8(10(12)13)4-2-6-11-9;11-7(12)8(13)14-6-5-10-3-1-9-2-4-10/h2,4,6H,3,5,7H2,1H3;9H,1-6H2,(H,11,12)