4-methyl-6-oxidanylidene-2-[(3-oxidanylpropylazaniumyl)methyl]benzo[c]chromen-3-olate

Systemtic Name: 4-methyl-6-oxidanylidene-2-[(3-oxidanylpropylazaniumyl)methyl]benzo[c]chromen-3-olate Openeye Name: 2-[(3-hydroxypropylammonio)methyl]-4-methyl-6-oxo-benzo[c]chromen-3-olate CAS Name: 2-[(3-hydroxypropylammonio)methyl]-4-methyl-6-oxo-3-benzo[c][1]benzopyranolate IUPAC Name: 2-[(3-hydroxypropylazaniumyl)methyl]-4-methyl-6-oxobenzo[c]chromen-3-olate Traditional Name: 2-[(3-hydroxypropylammonio)methyl]-6-keto-4-methyl-benzo[c]chromen-3-olate Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1[O-])C[NH2+]CCCO)C3=CC=CC=C3C(=O)O2

Isomeric SMILES

CC1=C2C(=CC(=C1[O-])C[NH2+]CCCO)C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C18H19NO4/c1-11-16(21)12(10-19-7-4-8-20)9-15-13-5-2-3-6-14(13)18(22)23-17(11)15/h2-3,5-6,9,19-21H,4,7-8,10H2,1H3