[1-(diphenylmethyl)azetidin-1-ium-3-yl] 3,3-bis(azanyl)prop-2-enoate

Systemtic Name: [1-(diphenylmethyl)azetidin-1-ium-3-yl] 3,3-bis(azanyl)prop-2-enoate Openeye Name: (1-benzhydrylazetidin-1-ium-3-yl) 3,3-diaminoprop-2-enoate CAS Name: 3,3-diamino-2-propenoic acid [1-(diphenylmethyl)-3-azetidin-1-iumyl] ester IUPAC Name: (1-benzhydrylazetidin-1-ium-3-yl) 3,3-diaminoprop-2-enoate Traditional Name: 3,3-diaminoacrylic acid (1-benzhydrylazetidin-1-ium-3-yl) ester Formula: C19H22N3O2+ MolecularWeight: 324.39688

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C=C(N)N

Isomeric SMILES

C1C(C[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C=C(N)N

InChI

InChI=1S/C19H21N3O2/c20-17(21)11-18(23)24-16-12-22(13-16)19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-11,16,19H,12-13,20-21H2/p+1