2-(6-ethyl-3-isocyano-4-phenylazanyl-quinolin-7-yl)ethyl-methyl-oxidanylidene-phosphanium

Systemtic Name: 2-(6-ethyl-3-isocyano-4-phenylazanyl-quinolin-7-yl)ethyl-methyl-oxidanylidene-phosphanium Openeye Name: 2-(4-anilino-6-ethyl-3-isocyano-7-quinolyl)ethyl-methyl-oxo-phosphonium CAS Name: 2-(4-anilino-6-ethyl-3-isocyano-7-quinolinyl)ethyl-methyl-oxophosphonium IUPAC Name: 2-(4-anilino-6-ethyl-3-isocyanoquinolin-7-yl)ethyl-methyl-oxophosphanium Traditional Name: 2-(4-anilino-6-ethyl-3-isocyano-7-quinolyl)ethyl-keto-methyl-phosphonium Formula: C21H21N3OP+ MolecularWeight: 362.384701

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=C(C=N2)[N+]#[C-])NC3=CC=CC=C3)CC[P+](=O)C

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=C(C=N2)[N+]#[C-])NC3=CC=CC=C3)CC[P+](=O)C

InChI

InChI=1S/C21H21N3OP/c1-4-15-12-18-19(13-16(15)10-11-26(3)25)23-14-20(22-2)21(18)24-17-8-6-5-7-9-17/h5-9,12-14H,4,10-11H2,1,3H3,(H,23,24)/q+1