diethyl-[2-(9-methoxy-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethyl]azanium

Systemtic Name: diethyl-[2-(9-methoxy-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethyl]azanium Openeye Name: diethyl-[2-(9-methoxy-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)ethyl]ammonium CAS Name: diethyl-[2-(9-methoxy-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)ethyl]ammonium IUPAC Name: diethyl-[2-(9-methoxy-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)ethyl]azanium Traditional Name: diethyl-[2-(4-keto-9-methoxy-5H-pyrimid[5,4-b]indol-3-yl)ethyl]ammonium Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C=NC2=C(C1=O)NC3=C2C(=CC=C3)OC

Isomeric SMILES

CC[NH+](CC)CCN1C=NC2=C(C1=O)NC3=C2C(=CC=C3)OC

InChI

InChI=1S/C17H22N4O2/c1-4-20(5-2)9-10-21-11-18-15-14-12(19-16(15)17(21)22)7-6-8-13(14)23-3/h6-8,11,19H,4-5,9-10H2,1-3H3/p+1