methyl 3-[[8-(naphthalen-1-ylcarbamoyl)-3,8-diazaspiro[4.5]decan-3-yl]carbonyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[8-(naphthalen-1-ylcarbamoyl)-3,8-diazaspiro[4.5]decan-3-yl]carbonyl]-5-nitro-benzoate Openeye Name: methyl 3-[8-(1-naphthylcarbamoyl)-3,8-diazaspiro[4.5]decane-3-carbonyl]-5-nitro-benzoate CAS Name: 3-[[8-[(1-naphthalenylamino)-oxomethyl]-3,8-diazaspiro[4.5]decan-3-yl]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[8-(naphthalen-1-ylcarbamoyl)-3,8-diazaspiro[4.5]decane-3-carbonyl]-5-nitrobenzoate Traditional Name: 3-[8-(1-naphthylcarbamoyl)-3,8-diazaspiro[4.5]decane-3-carbonyl]-5-nitro-benzoic acid methyl ester Formula: C28H28N4O6 MolecularWeight: 516.54512

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)N2CCC3(C2)CCN(CC3)C(=O)NC4=CC=CC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)N2CCC3(C2)CCN(CC3)C(=O)NC4=CC=CC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C28H28N4O6/c1-38-26(34)21-15-20(16-22(17-21)32(36)37)25(33)31-14-11-28(18-31)9-12-30(13-10-28)27(35)29-24-8-4-6-19-5-2-3-7-23(19)24/h2-8,15-17H,9-14,18H2,1H3,(H,29,35)