9H-fluoren-1-ylmethyl 7,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-ium-10-carboxylate

Systemtic Name: 9H-fluoren-1-ylmethyl 7,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-ium-10-carboxylate Openeye Name: 9H-fluoren-1-ylmethyl 7,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-ium-10-carboxylate CAS Name: 7,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-ium-10-carboxylic acid 9H-fluoren-1-ylmethyl ester IUPAC Name: 9H-fluoren-1-ylmethyl 7,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-ium-10-carboxylate Traditional Name: 7,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-ium-10-carboxylic acid 9H-fluoren-1-ylmethyl ester Formula: C27H23N2O2+ MolecularWeight: 407.48372

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C[N+]2(C1=CNC3=CC=CC=C3C2)C(=O)OCC4=CC=CC5=C4CC6=CC=CC=C65

Isomeric SMILES

C1C=C[N+]2(C1=CNC3=CC=CC=C3C2)C(=O)OCC4=CC=CC5=C4CC6=CC=CC=C65

InChI

InChI=1S/C27H23N2O2/c30-27(29-14-6-10-22(29)16-28-26-13-4-2-8-20(26)17-29)31-18-21-9-5-12-24-23-11-3-1-7-19(23)15-25(21)24/h1-9,11-14,16,28H,10,15,17-18H2/q+1