ethyl 2-(2,3,9,10-tetrahydro-1H-pyrrolo[2,1-b]quinazolin-10-ium-3-yloxycarbonylamino)ethanoate

Systemtic Name: ethyl 2-(2,3,9,10-tetrahydro-1H-pyrrolo[2,1-b]quinazolin-10-ium-3-yloxycarbonylamino)ethanoate Openeye Name: ethyl 2-(2,3,9,10-tetrahydro-1H-pyrrolo[2,1-b]quinazolin-10-ium-3-yloxycarbonylamino)acetate CAS Name: 2-[[oxo(2,3,9,10-tetrahydro-1H-pyrrolo[2,1-b]quinazolin-10-ium-3-yloxy)methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-(2,3,9,10-tetrahydro-1H-pyrrolo[2,1-b]quinazolin-10-ium-3-yloxycarbonylamino)acetate Traditional Name: 2-(2,3,9,10-tetrahydro-1H-pyrrolo[2,1-b]quinazolin-10-ium-3-yloxycarbonylamino)acetic acid ethyl ester Formula: C16H20N3O4+ MolecularWeight: 318.3477

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)OC1CC[NH+]2C1=NC3=CC=CC=C3C2

Isomeric SMILES

CCOC(=O)CNC(=O)OC1CC[NH+]2C1=NC3=CC=CC=C3C2

InChI

InChI=1S/C16H19N3O4/c1-2-22-14(20)9-17-16(21)23-13-7-8-19-10-11-5-3-4-6-12(11)18-15(13)19/h3-6,13H,2,7-10H2,1H3,(H,17,21)/p+1