[3-[2-(methoxycarbonylamino)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]-3-oxidanylidene-propyl]-methyl-azanium

Systemtic Name: [3-[2-(methoxycarbonylamino)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]-3-oxidanylidene-propyl]-methyl-azanium Openeye Name: [3-[2-(methoxycarbonylamino)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]-3-oxo-propyl]-methyl-ammonium CAS Name: [3-[2-(methoxycarbonylamino)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]-3-oxopropyl]-methylammonium IUPAC Name: [3-[2-(methoxycarbonylamino)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]-3-oxopropyl]-methylazanium Traditional Name: [3-[2-(carbomethoxyamino)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]-3-keto-propyl]-methyl-ammonium Formula: C20H24N3O3+ MolecularWeight: 354.42286

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)NC(=O)OC

Isomeric SMILES

C[NH2+]CCC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)NC(=O)OC

InChI

InChI=1S/C20H23N3O3/c1-21-12-11-19(24)23-17-6-4-3-5-14(17)7-8-15-9-10-16(13-18(15)23)22-20(25)26-2/h3-6,9-10,13,21H,7-8,11-12H2,1-2H3,(H,22,25)/p+1