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

Systemtic Name: 2-ethoxyethyl (Z)-2-cyano-4-methyl-3-(quinolin-3-ylmethylamino)pent-2-enoate Openeye Name: 2-ethoxyethyl (Z)-2-cyano-4-methyl-3-(3-quinolylmethylamino)pent-2-enoate CAS Name: (Z)-2-cyano-4-methyl-3-(3-quinolinylmethylamino)-2-pentenoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl (Z)-2-cyano-4-methyl-3-(quinolin-3-ylmethylamino)pent-2-enoate Traditional Name: (Z)-2-cyano-4-methyl-3-(3-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=CC=CC=C2N=C1)C#N

Isomeric SMILES

CCOCCOC(=O)/C(=C(/C(C)C)\NCC1=CC2=CC=CC=C2N=C1)/C#N

InChI

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