ethyl 7-chloranyl-2-[(phenylmethyl)-prop-2-enyl-amino]hept-3-ynoate

Systemtic Name: ethyl 7-chloranyl-2-[(phenylmethyl)-prop-2-enyl-amino]hept-3-ynoate Openeye Name: ethyl 2-[allyl(benzyl)amino]-7-chloro-hept-3-ynoate CAS Name: 7-chloro-2-[(phenylmethyl)-prop-2-enylamino]-3-heptynoic acid ethyl ester IUPAC Name: ethyl 2-[benzyl(prop-2-enyl)amino]-7-chlorohept-3-ynoate Traditional Name: 2-[allyl(benzyl)amino]-7-chloro-hept-3-ynoic acid ethyl ester Formula: C19H24ClNO2 MolecularWeight: 333.85236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#CCCCCl)N(CC=C)CC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)C(C#CCCCCl)N(CC=C)CC1=CC=CC=C1

InChI

InChI=1S/C19H24ClNO2/c1-3-15-21(16-17-11-7-5-8-12-17)18(19(22)23-4-2)13-9-6-10-14-20/h3,5,7-8,11-12,18H,1,4,6,10,14-16H2,2H3