6,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-6-ylmethyl-ethyl-methoxycarbonyl-methyl-azanium

Systemtic Name: 6,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-6-ylmethyl-ethyl-methoxycarbonyl-methyl-azanium Openeye Name: 6,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-6-ylmethyl-ethyl-methoxycarbonyl-methyl-ammonium CAS Name: 6,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-6-ylmethyl-ethyl-methoxycarbonyl-methylammonium IUPAC Name: 6,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-6-ylmethyl-ethyl-methoxycarbonyl-methylazanium Traditional Name: carbomethoxy-(6,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-6-ylmethyl)-ethyl-methyl-ammonium Formula: C18H24N3O2+ MolecularWeight: 314.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC1C2=CC=CN2CC3=CC=CC=C3N1)C(=O)OC

Isomeric SMILES

CC[N+](C)(CC1C2=CC=CN2CC3=CC=CC=C3N1)C(=O)OC

InChI

InChI=1S/C18H24N3O2/c1-4-21(2,18(22)23-3)13-16-17-10-7-11-20(17)12-14-8-5-6-9-15(14)19-16/h5-11,16,19H,4,12-13H2,1-3H3/q+1