ethyl (4E,6E)-1-prop-2-enyl-1-azacyclopentadeca-4,6-dien-10-yne-7-carboxylate

Systemtic Name: ethyl (4E,6E)-1-prop-2-enyl-1-azacyclopentadeca-4,6-dien-10-yne-7-carboxylate Openeye Name: ethyl (4E,6E)-1-allyl-1-azacyclopentadeca-4,6-dien-10-yne-7-carboxylate CAS Name: (4E,6E)-1-prop-2-enyl-1-azacyclopentadeca-4,6-dien-10-yne-7-carboxylic acid ethyl ester IUPAC Name: ethyl (4E,6E)-1-prop-2-enyl-1-azacyclopentadeca-4,6-dien-10-yne-7-carboxylate Traditional Name: (4E,6E)-1-allyl-1-azacyclopentadeca-4,6-dien-10-yne-7-carboxylic acid ethyl ester Formula: C20H29NO2 MolecularWeight: 315.44976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CCCN(CCCCC#CCC1)CC=C

Isomeric SMILES

CCOC(=O)/C/1=C/C=C/CCN(CCCCC#CCC1)CC=C

InChI

InChI=1S/C20H29NO2/c1-3-16-21-17-12-8-6-5-7-10-14-19(20(22)23-4-2)15-11-9-13-18-21/h3,9,11,15H,1,4,6,8,10,12-14,16-18H2,2H3/b11-9+,19-15+