dihydrogen phosphate; 6-prop-2-enyl-6,7-dihydro-5H-benzo[d][2]benzazepin-6-ium

Systemtic Name: dihydrogen phosphate; 6-prop-2-enyl-6,7-dihydro-5H-benzo[d][2]benzazepin-6-ium Openeye Name: 6-allyl-6,7-dihydro-5H-benzo[d][2]benzazepin-6-ium; dihydrogen phosphate CAS Name: dihydrogen phosphate; 6-prop-2-enyl-6,7-dihydro-5H-benzo[d][2]benzazepin-6-ium IUPAC Name: dihydrogen phosphate; 6-prop-2-enyl-6,7-dihydro-5H-benzo[d][2]benzazepin-6-ium Traditional Name: 6-allyl-6,7-dihydro-5H-benzo[d][2]benzazepin-6-ium; dihydrogen phosphate Formula: C17H20NO4P MolecularWeight: 333.318761

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+]1CC2=CC=CC=C2C3=CC=CC=C3C1.OP(=O)(O)[O-]

Isomeric SMILES

C=CC[NH+]1CC2=CC=CC=C2C3=CC=CC=C3C1.OP(=O)(O)[O-]

InChI

InChI=1S/C17H17N.H3O4P/c1-2-11-18-12-14-7-3-5-9-16(14)17-10-6-4-8-15(17)13-18;1-5(2,3)4/h2-10H,1,11-13H2;(H3,1,2,3,4)