phenyl 3-[3-(1-azanylethenylamino)propyl]-2,2-dimethyl-4-oxidanylidene-azetidine-1-sulfinate

Systemtic Name: phenyl 3-[3-(1-azanylethenylamino)propyl]-2,2-dimethyl-4-oxidanylidene-azetidine-1-sulfinate Openeye Name: phenyl 3-[3-(1-aminovinylamino)propyl]-2,2-dimethyl-4-oxo-azetidine-1-sulfinate CAS Name: 3-[3-(1-aminoethenylamino)propyl]-2,2-dimethyl-4-oxo-1-azetidinesulfinic acid phenyl ester IUPAC Name: phenyl 3-[3-(1-aminoethenylamino)propyl]-2,2-dimethyl-4-oxoazetidine-1-sulfinate Traditional Name: 3-[3-(1-aminovinylamino)propyl]-4-keto-2,2-dimethyl-azetidine-1-sulfinic acid phenyl ester Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)N1S(=O)OC2=CC=CC=C2)CCCNC(=C)N)C

Isomeric SMILES

CC1(C(C(=O)N1S(=O)OC2=CC=CC=C2)CCCNC(=C)N)C

InChI

InChI=1S/C16H23N3O3S/c1-12(17)18-11-7-10-14-15(20)19(16(14,2)3)23(21)22-13-8-5-4-6-9-13/h4-6,8-9,14,18H,1,7,10-11,17H2,2-3H3