1-butyl-5-[(E,3Z)-3-[1-butyl-5-cyano-4-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]prop-1-enyl]-3-isocyano-6-oxidanylidene-4-pentyl-pyridin-2-olate

Systemtic Name: 1-butyl-5-[(E,3Z)-3-[1-butyl-5-cyano-4-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]prop-1-enyl]-3-isocyano-6-oxidanylidene-4-pentyl-pyridin-2-olate Openeye Name: 1-butyl-5-[(E,3Z)-3-(1-butyl-5-cyano-4-methyl-2,6-dioxo-3-pyridylidene)prop-1-enyl]-3-isocyano-6-oxo-4-pentyl-pyridin-2-olate CAS Name: 1-butyl-5-[(E,3Z)-3-(1-butyl-5-cyano-4-methyl-2,6-dioxo-3-pyridinylidene)prop-1-enyl]-3-isocyano-6-oxo-4-pentyl-2-pyridinolate IUPAC Name: 1-butyl-5-[(E,3Z)-3-(1-butyl-5-cyano-4-methyl-2,6-dioxopyridin-3-ylidene)prop-1-enyl]-3-isocyano-6-oxo-4-pentylpyridin-2-olate Traditional Name: 4-amyl-1-butyl-5-[(E,3Z)-3-(1-butyl-5-cyano-2,6-diketo-4-methyl-3-pyridylidene)prop-1-enyl]-3-isocyano-6-keto-pyridin-2-olate Formula: C29H35N4O4- MolecularWeight: 503.6126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=O)N(C(=C1[N+]#[C-])[O-])CCCC)C=CC=C2C(=C(C(=O)N(C2=O)CCCC)C#N)C

Isomeric SMILES

CCCCCC1=C(C(=O)N(C(=C1[N+]#[C-])[O-])CCCC)/C=C/C=C\2/C(=C(C(=O)N(C2=O)CCCC)C#N)C

InChI

InChI=1S/C29H36N4O4/c1-6-9-12-14-22-23(27(35)33(18-11-8-3)29(37)25(22)31-5)16-13-15-21-20(4)24(19-30)28(36)32(26(21)34)17-10-7-2/h13,15-16,37H,6-12,14,17-18H2,1-4H3/p-1/b16-13+,21-15-