2-ethoxyethyl (Z)-2-cyano-4-methyl-3-(quinolin-6-ylmethylamino)pent-2-enoate

Systemtic Name: 2-ethoxyethyl (Z)-2-cyano-4-methyl-3-(quinolin-6-ylmethylamino)pent-2-enoate Openeye Name: 2-ethoxyethyl (Z)-2-cyano-4-methyl-3-(6-quinolylmethylamino)pent-2-enoate CAS Name: (Z)-2-cyano-4-methyl-3-(6-quinolinylmethylamino)-2-pentenoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl (Z)-2-cyano-4-methyl-3-(quinolin-6-ylmethylamino)pent-2-enoate Traditional Name: (Z)-2-cyano-4-methyl-3-(6-quinolylmethylamino)pent-2-enoic acid 2-ethoxyethyl ester Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C(=C(C(C)C)NCC1=CC2=C(C=C1)N=CC=C2)C#N

Isomeric SMILES

CCOCCOC(=O)/C(=C(/C(C)C)\NCC1=CC2=C(C=C1)N=CC=C2)/C#N

InChI

InChI=1S/C21H25N3O3/c1-4-26-10-11-27-21(25)18(13-22)20(15(2)3)24-14-16-7-8-19-17(12-16)6-5-9-23-19/h5-9,12,15,24H,4,10-11,14H2,1-3H3/b20-18-