4-(1,2-diazepin-1-yl)butyl hydrogen carbonate

Systemtic Name: 4-(1,2-diazepin-1-yl)butyl hydrogen carbonate Openeye Name: 4-(diazepin-1-yl)butyl hydrogen carbonate CAS Name: carbonic acid 4-(1-diazepinyl)butyl ester IUPAC Name: 4-(diazepin-1-yl)butyl hydrogen carbonate Traditional Name: carbonic acid 4-(diazepin-1-yl)butyl ester Formula: C10H14N2O3 MolecularWeight: 210.22976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NN(C=C1)CCCCOC(=O)O

Isomeric SMILES

C1=CC=NN(C=C1)CCCCOC(=O)O

InChI

InChI=1S/C10H14N2O3/c13-10(14)15-9-5-4-8-12-7-3-1-2-6-11-12/h1-3,6-7H,4-5,8-9H2,(H,13,14)