diethyl-[2-(7-methoxy-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethyl]azanium

Systemtic Name: diethyl-[2-(7-methoxy-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethyl]azanium Openeye Name: diethyl-[2-(7-methoxy-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)ethyl]ammonium CAS Name: diethyl-[2-(7-methoxy-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)ethyl]ammonium IUPAC Name: diethyl-[2-(7-methoxy-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)ethyl]azanium Traditional Name: diethyl-[2-(4-keto-7-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)8-9-21-11-18-15-13-7-6-12(23-3)10-14(13)19-16(15)17(21)22/h6-7,10-11,19H,4-5,8-9H2,1-3H3/p+1