4-nitrooxybutyl 3-[2-(6-methoxynaphthalen-2-yl)propanoyl]-1,3-thiazolidine-4-carboxylate

Systemtic Name: 4-nitrooxybutyl 3-[2-(6-methoxynaphthalen-2-yl)propanoyl]-1,3-thiazolidine-4-carboxylate Openeye Name: 4-nitrooxybutyl 3-[2-(6-methoxy-2-naphthyl)propanoyl]thiazolidine-4-carboxylate CAS Name: 3-[2-(6-methoxy-2-naphthalenyl)-1-oxopropyl]-4-thiazolidinecarboxylic acid 4-nitrooxybutyl ester IUPAC Name: 4-nitrooxybutyl 3-[2-(6-methoxynaphthalen-2-yl)propanoyl]-1,3-thiazolidine-4-carboxylate Traditional Name: 3-[2-(6-methoxy-2-naphthyl)propanoyl]thiazolidine-4-carboxylic acid 4-nitrooxybutyl ester Formula: C22H26N2O7S MolecularWeight: 462.51604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)N3CSCC3C(=O)OCCCCO[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)N3CSCC3C(=O)OCCCCO[N+](=O)[O-]

InChI

InChI=1S/C22H26N2O7S/c1-15(16-5-6-18-12-19(29-2)8-7-17(18)11-16)21(25)23-14-32-13-20(23)22(26)30-9-3-4-10-31-24(27)28/h5-8,11-12,15,20H,3-4,9-10,13-14H2,1-2H3