4-(2-azanyl-1-chloranyl-5-phenyl-cyclohexa-2,4-dien-1-yl)hepta-2,5-diyn-4-ol

Systemtic Name: 4-(2-azanyl-1-chloranyl-5-phenyl-cyclohexa-2,4-dien-1-yl)hepta-2,5-diyn-4-ol Openeye Name: 4-(2-amino-1-chloro-5-phenyl-cyclohexa-2,4-dien-1-yl)hepta-2,5-diyn-4-ol CAS Name: 4-(2-amino-1-chloro-5-phenyl-1-cyclohexa-2,4-dienyl)-4-hepta-2,5-diynol IUPAC Name: 4-(2-amino-1-chloro-5-phenylcyclohexa-2,4-dien-1-yl)hepta-2,5-diyn-4-ol Traditional Name: 4-(2-amino-1-chloro-5-phenyl-cyclohexa-2,4-dien-1-yl)hepta-2,5-diyn-4-ol Formula: C19H18ClNO MolecularWeight: 311.80532

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C#CC)(C1(CC(=CC=C1N)C2=CC=CC=C2)Cl)O

Isomeric SMILES

CC#CC(C#CC)(C1(CC(=CC=C1N)C2=CC=CC=C2)Cl)O

InChI

InChI=1S/C19H18ClNO/c1-3-12-18(22,13-4-2)19(20)14-16(10-11-17(19)21)15-8-6-5-7-9-15/h5-11,22H,14,21H2,1-2H3