[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: [(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: [(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-[(7-methoxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: [(1S)-1-(4-ethylphenyl)-2-methylpropyl]-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: [(1S)-1-(4-ethylphenyl)-2-methylpropyl]-[(7-methoxy-2-oxochromen-4-yl)methyl]azanium Traditional Name: [(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-[(2-keto-7-methoxy-chromen-4-yl)methyl]ammonium Formula: C23H28NO3+ MolecularWeight: 366.47332

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(C)C)[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C23H27NO3/c1-5-16-6-8-17(9-7-16)23(15(2)3)24-14-18-12-22(25)27-21-13-19(26-4)10-11-20(18)21/h6-13,15,23-24H,5,14H2,1-4H3/p+1/t23-/m0/s1