N-[2-[2-methoxyethyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-N-prop-2-enyl-heptanamide

Systemtic Name: N-[2-[2-methoxyethyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-N-prop-2-enyl-heptanamide Openeye Name: N-allyl-N-[2-[(1-benzylpyrrol-2-yl)methyl-(2-methoxyethyl)amino]-2-oxo-ethyl]heptanamide CAS Name: N-[2-[2-methoxyethyl-[[1-(phenylmethyl)-2-pyrrolyl]methyl]amino]-2-oxoethyl]-N-prop-2-enylheptanamide IUPAC Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-(2-methoxyethyl)amino]-2-oxoethyl]-N-prop-2-enylheptanamide Traditional Name: N-allyl-N-[2-[(1-benzylpyrrol-2-yl)methyl-(2-methoxyethyl)amino]-2-keto-ethyl]enanthamide Formula: C27H39N3O3 MolecularWeight: 453.61686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N(CC=C)CC(=O)N(CCOC)CC1=CC=CN1CC2=CC=CC=C2

Isomeric SMILES

CCCCCCC(=O)N(CC=C)CC(=O)N(CCOC)CC1=CC=CN1CC2=CC=CC=C2

InChI

InChI=1S/C27H39N3O3/c1-4-6-7-11-16-26(31)29(17-5-2)23-27(32)30(19-20-33-3)22-25-15-12-18-28(25)21-24-13-9-8-10-14-24/h5,8-10,12-15,18H,2,4,6-7,11,16-17,19-23H2,1,3H3