methyl (1S)-8-[(4-methoxynaphthalen-1-yl)methyl]-3-oxidanylidene-4-prop-2-enyl-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate

Systemtic Name: methyl (1S)-8-[(4-methoxynaphthalen-1-yl)methyl]-3-oxidanylidene-4-prop-2-enyl-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate Openeye Name: methyl (1S)-4-allyl-8-[(4-methoxy-1-naphthyl)methyl]-3-oxo-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate CAS Name: (1S)-8-[(4-methoxy-1-naphthalenyl)methyl]-3-oxo-4-prop-2-enyl-4-aza-8-azoniaspiro[4.5]decane-1-carboxylic acid methyl ester IUPAC Name: methyl (1S)-8-[(4-methoxynaphthalen-1-yl)methyl]-3-oxo-4-prop-2-enyl-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate Traditional Name: (1S)-4-allyl-3-keto-8-[(4-methoxy-1-naphthyl)methyl]-4-aza-8-azoniaspiro[4.5]decane-1-carboxylic acid methyl ester Formula: C25H31N2O4+ MolecularWeight: 423.52464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C2=CC=CC=C21)C[NH+]3CCC4(CC3)C(CC(=O)N4CC=C)C(=O)OC

Isomeric SMILES

COC1=CC=C(C2=CC=CC=C21)C[NH+]3CCC4(CC3)[C@H](CC(=O)N4CC=C)C(=O)OC

InChI

InChI=1S/C25H30N2O4/c1-4-13-27-23(28)16-21(24(29)31-3)25(27)11-14-26(15-12-25)17-18-9-10-22(30-2)20-8-6-5-7-19(18)20/h4-10,21H,1,11-17H2,2-3H3/p+1/t21-/m1/s1