3-methylbutyl 2-[4-(prop-2-enoylamino)butoxy]benzoate

Systemtic Name: 3-methylbutyl 2-[4-(prop-2-enoylamino)butoxy]benzoate Openeye Name: isopentyl 2-[4-(prop-2-enoylamino)butoxy]benzoate CAS Name: 2-[4-(1-oxoprop-2-enylamino)butoxy]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[4-(prop-2-enoylamino)butoxy]benzoate Traditional Name: 2-(4-acrylamidobutoxy)benzoic acid isoamyl ester Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=CC=CC=C1OCCCCNC(=O)C=C

Isomeric SMILES

CC(C)CCOC(=O)C1=CC=CC=C1OCCCCNC(=O)C=C

InChI

InChI=1S/C19H27NO4/c1-4-18(21)20-12-7-8-13-23-17-10-6-5-9-16(17)19(22)24-14-11-15(2)3/h4-6,9-10,15H,1,7-8,11-14H2,2-3H3,(H,20,21)