2-chloranyl-6-oxidanylidene-4-[(propylazaniumyl)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-3-olate

Systemtic Name: 2-chloranyl-6-oxidanylidene-4-[(propylazaniumyl)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-3-olate Openeye Name: 2-chloro-6-oxo-4-[(propylammonio)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-3-olate CAS Name: 2-chloro-6-oxo-4-[(propylammonio)methyl]-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-3-olate IUPAC Name: 2-chloro-6-oxo-4-[(propylazaniumyl)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-3-olate Traditional Name: 2-chloro-6-keto-4-[(propylammonio)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-3-olate Formula: C17H20ClNO3 MolecularWeight: 321.7986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC1=C2C(=CC(=C1[O-])Cl)C3=C(CCCC3)C(=O)O2

Isomeric SMILES

CCC[NH2+]CC1=C2C(=CC(=C1[O-])Cl)C3=C(CCCC3)C(=O)O2

InChI

InChI=1S/C17H20ClNO3/c1-2-7-19-9-13-15(20)14(18)8-12-10-5-3-4-6-11(10)17(21)22-16(12)13/h8,19-20H,2-7,9H2,1H3